4′-Demethylpodophyllotoxin
CAS Registry Number®
40505-27-9
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CAS Name
4′-DemethylpodophyllotoxinMolecular Formula
C21H20O8Molecular Mass
400.38Cite this Page
4′-Demethylpodophyllotoxin. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=40505-27-9 (retrieved ) (CAS RN: 40505-27-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
250-252 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C21H20O8/c1-25-15-3-9(4-16(26-2)20(15)23)17-10-5-13-14(29-8-28-13)6-11(10)19(22)12-7-27-21(24)18(12)17/h3-6,12,17-19,22-23H,7-8H2,1-2H3/t12-,17+,18-,19-/m0/s1
InChIKey
InChIKey=YVCVYCSAAZQOJI-BTINSWFASA-N
SMILES
O=C1[C@@]2([C@@H](C=3C([C@H](O)[C@]2(CO1)[H])=CC4=C(C3)OCO4)C5=CC(OC)=C(O)C(OC)=C5)[H]
Canonical SMILES
O=C1OCC2C(O)C3=CC=4OCOC4C=C3C(C5=CC(OC)=C(O)C(OC)=C5)C12
Other Names for this Substance
- Furo[3′,4′:6,7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one, 5,8,8a,9-tetrahydro-9-hydroxy-5-(4-hydroxy-3,5-dimethoxyphenyl)-, (5R,5aR,8aR,9R)-
- Furo[3′,4′:6,7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one, 5,8,8a,9-tetrahydro-9-hydroxy-5-(4-hydroxy-3,5-dimethoxyphenyl)-, [5R-(5α,5aβ,8aα,9α)]-
- Podophyllotoxin, 4′-demethyl-
- (5R,5aR,8aR,9R)-5,8,8a,9-Tetrahydro-9-hydroxy-5-(4-hydroxy-3,5-dimethoxyphenyl)furo[3′,4′:6,7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one
- 4′-Demethylpodophyllotoxin
